(-)-Quinic acid

CAS Registry Number®

77-95-2
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CAS Name

(-)-Quinic acid

Molecular Formula

C7H12O6

Molecular Mass

192.17

Cite this Page

(-)-Quinic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77-95-2 (retrieved 2024-07-16) (CAS RN: 77-95-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    162.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1

InChIKey

InChIKey=AAWZDTNXLSGCEK-WYWMIBKRSA-N

SMILES

C(O)(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](O)C1

Canonical SMILES

O=C(O)C1(O)CC(O)C(O)C(O)C1

Other Names for this Substance

  • Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (1α,3R,4α,5R)-
  • Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, (-)-
  • Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, [1R-(1α,3α,4α,5β)]-
  • (1α,3R,4α,5R)-1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid
  • D-Quinic acid

Deleted or Replaced CAS Registry Numbers

35949-55-4